Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | WNT1 | P04628 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | HPGDS | O60760 | 1/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ACP1 | P24666 | 1/20 | 0.41 |
| ▸ | ROS1 | P08922 | 1/20 | 0.41 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.41 |
| ▸ | ACACB | O00763 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL3715077 | 0.89 | AURKA (0.45) | SMN1; SMN2WNT1DYRK1AHPGDSCYP1A2 | |
| SCHEMBL3792256 | 0.87 | P2RY12 (0.46) | SMN1; SMN2WNT1DYRK1AHDAC1CYP1A2 | |
| SCHEMBL13188496 | 0.86 | HDAC1 (0.48) | KDM1AHDAC1HDAC6 | |
| SCHEMBL13188606 | 0.86 | CYP3A4 (0.45) | SMN1; SMN2WNT1DYRK1AHPGDSKDM1A | |
| SCHEMBL13187836 | 0.85 | WNT1 (0.42) | SMN1; SMN2WNT1DYRK1AHPGDSCYP1A2 | |
| SCHEMBL13188365 | 0.85 | HDAC1 (0.50) | SMN1; SMN2DYRK1AHPGDSKDM1AHDAC1 | |
| SCHEMBL13187706 | 0.82 | FGFR4 (0.39) | SMN1; SMN2HDAC1CYP1A2CYP3A4MEN1 | |
| SCHEMBL13188771 | 0.82 | PIK3CA (0.48) | SMN1; SMN2KDM1AHDAC1CYP1A2CYP3A4 | |
| SCHEMBL13188345 | 0.81 | GRM5 (0.39) | HDAC1ACACBHDAC6HIF1AEPAS1 | |
| SCHEMBL3714257 | 0.81 | CYP3A4 (0.47) | SMN1; SMN2WNT1DYRK1ACYP1A2CYP3A4 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010100475-A1 | HYDROXAMIC ACID DERIVATIVES AS GRAM-NEGATIVE ANTIBACTERIAL AGENTS | ASTRAZENECA AB (SE) | 2010-09-10 | — | — | WO | disclosed |